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Prediction of Henry's law constant of benzene derivatives using quantum chemical continuum-solvation models.

Gerrit Schüürmann
Published in: J. Comput. Chem. (2000)
Keyphrases
  • prediction model
  • models built
  • prior knowledge
  • complex systems
  • bayesian framework
  • machine learning
  • case study
  • model selection
  • prediction accuracy
  • computational models
  • legal reasoning